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MolNFT v1 · #127522 · protein

Crystal structure of full-lengh csfv NS3/4A

5MZ4 · Genome POLYPROTEIN,GENOME polyprotein: “Crystal structure of full-lengh csfv NS3/4A”. X-ray diffraction, 20 pockets (best druggability 0.67). MolNFT v1 #127522 on GenesisL1: 3D structure, binding sites and pockets in GL1X.

PDB
5MZ4
Type
protein
Length
1,383 residues
Chains
2
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Genome POLYPROTEIN,GENOME polyprotein
EC
3.4.22.-, 3.4.21.113, 3.6.1.15, 3.6.4.13, 2.7.7.48
UniProt
P19712
Pockets
20 · best druggability 0.67

Structure

x-ray diffraction · 2 distinct chains · 27% helix, 30% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
AGenome POLYPROTEIN,GENOME polyprotein (EC 3.4.22.-, 3.4.21.113, 3.6.1.15, 3.6.4.13, 2.7.7.48)protein70427% helix, 31% strandP19712
BGenome POLYPROTEIN,GENOME polyprotein (EC 3.4.22.-, 3.4.21.113, 3.6.1.15, 3.6.4.13, 2.7.7.48)protein67928% helix, 29% strandP19712

Pockets

20 pockets found on a 1 Å grid, 9 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
15240.670.7844empty
22300.660.8335empty
31910.650.8529empty
42060.640.8335empty
52550.590.7931empty

Interfaces

1 interface between chains.

  • A–B · 2479 Ų buried · 63 hydrogen bonds · protein-protein

Compared structures

  • 5MZ4 · Crystal Structure of full-lengh CSFV NS3/4A · the same entry in another collection · chain A against A, TM-score 1.00

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